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3H-pyrazol-3-one, 1-[(2-chlorophenyl)methyl]-1,2-dihydro-4-methyl-
SpectraBase Compound ID JmsEDgKQsfu
InChI InChI=1S/C11H11ClN2O/c1-8-6-14(13-11(8)15)7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3,(H,13,15)
InChIKey UTOOZDHUHWJNSH-UHFFFAOYSA-N
Mol Weight 222.67 g/mol
Molecular Formula C11H11ClN2O
Exact Mass 222.055991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76eH9ogwdwx
Name 3H-pyrazol-3-one, 1-[(2-chlorophenyl)methyl]-1,2-dihydro-4-methyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClN2O
InChI InChI=1S/C11H11ClN2O/c1-8-6-14(13-11(8)15)7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3,(H,13,15)
InChIKey UTOOZDHUHWJNSH-UHFFFAOYSA-N
Molecular Weight 222.675 g/mol
SMILES N1C(C(=CN1Cc1ccccc1Cl)C)=O
SPLASH splash10-00di-8960000000-a55aac21e7c349ee8d76
Source of Spectrum JX-2015-0-556
Synonyms 1-(2-Chlorobenzyl)-4-methyl-1H-pyrazol-3(2H)-one 1-(2-Chlorobenzyl)-4-methyl-1,2-dihydro-3H-pyrazol-3-one 2-[(2-chlorophenyl)methyl]-4-methyl-1H-pyrazol-5-one
Wiley ID 1720482